%chk=000049437.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049437

0 1
 N  -8.8999998E-03  0.6477000      5.6100000E-02
 N    3.156600       4.317000     -0.1041000    
 C   -1.221700       1.334200      0.4995000    
 C   0.1338000     -0.6341000      0.7455000    
 C    1.166700       1.486300      0.2874000    
 C   -2.459100      0.5234000      0.2207000    
 C    1.374400      -1.369000      0.3121000    
 C    1.043200       2.798300     -0.4831000    
 C   -3.120300      0.6799000     -0.9895000    
 C    1.309100      -2.245000     -0.7626000    
 C   -2.921600     -0.3691000       1.177800    
 C    2.565500      -1.160600      0.9931000    
 C   -4.266900     -7.1199998E-02  -1.247900    
 C    2.458300      -2.926000      -1.164300    
 C   -4.068200      -1.120200      0.9192000    
 C    3.714600      -1.841700      0.5914000    
 C   -4.740900     -0.9714000     -0.2936000    
 C    3.661100      -2.724400     -0.4873000    
 C    2.224600       3.646100     -0.2705000    
 H   -1.383100       2.282200     -2.1199999E-02
 H   -1.175600       1.583400       1.569200    
 H  -0.6925000      -1.315400      0.5210000    
 H   0.1482000     -0.5093000       1.837500    
 H    1.319200       1.685800       1.356900    
 H    2.077400       1.022300     -0.1027000    
 H   0.9160000       2.604300      -1.554800    
 H   0.1944000       3.403300     -0.1534000    
 H   -2.759100       1.375500      -1.741800    
 H   0.3789000      -2.408200      -1.299600    
 H   -2.418800     -0.4849000       2.133800    
 H    2.620300     -0.4889000       1.845200    
 H   -4.790300      4.4199999E-02  -2.192600    
 H    2.416800      -3.612900      -2.004500    
 H   -4.439400      -1.818500       1.663700    
 H    4.650300      -1.687300       1.120700    
 H   -5.634100      -1.555700     -0.4945000    
 H    4.555700      -3.255100     -0.7997000    


%chk=000049437-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000049437

0 1
N 0.013787 0.749397 0.469079
N 2.793931 4.636047 -0.748830
C -1.301905 1.255045 0.934943
C 0.400635 -0.525088 1.130866
C 1.074489 1.780197 0.490893
C -2.479580 0.395122 0.483941
C 1.527040 -1.256056 0.409515
C 1.012932 2.653414 -0.796795
C -2.546743 -0.102444 -0.842212
C 1.495246 -1.418693 -0.999489
C -3.550797 0.124523 1.370209
C 2.602943 -1.820637 1.137506
C -3.662635 -0.852394 -1.272893
C 2.515075 -2.133883 -1.663822
C -4.672049 -0.623006 0.941328
C 3.624716 -2.541043 0.475794
C -4.731550 -1.113812 -0.382829
C 3.583747 -2.699813 -0.927902
C 1.991954 3.752615 -0.780717
H -1.428649 2.276669 0.525248
H -1.331273 1.362575 2.048347
H -0.504516 -1.163040 1.137114
H 0.685528 -0.367421 2.200843
H 1.011955 2.438113 1.389483
H 2.055696 1.277000 0.522960
H 1.198858 2.004676 -1.671996
H 0.000769 3.082920 -0.920943
H -1.710502 0.097581 -1.521573
H 0.667121 -0.972735 -1.561690
H -3.507427 0.498316 2.401200
H 2.642262 -1.696358 2.227183
H -3.701584 -1.232380 -2.300246
H 2.478203 -2.253650 -2.752769
H -5.492625 -0.825575 1.638865
H 4.451301 -2.971009 1.052694
H -5.597724 -1.695986 -0.716770
H 4.375971 -3.254188 -1.443435


